SCHEMBL27979174

SCHEMBL27979174

Cn1c(CN2CCC(CCC=O)CC2)nc2c(N3CCOCC3)nc(-n3c(CCO)nc4ccccc43)nc21

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 20/20 0.67
PIK3CB P42338 2/20 0.67
PIK3CA P42336 3/20 0.61
PIK3CG P48736 2/20 0.61

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL27979008 0.88 PIK3CD (0.76) PIK3CDPIK3CBPIK3CAPIK3CG
SCHEMBL2673859 0.88 PIK3CD (0.86) PIK3CDPIK3CBPIK3CAPIK3CG
SCHEMBL2674017 0.88 PIK3CD (0.69) PIK3CDPIK3CBPIK3CAPIK3CG
SCHEMBL2674356 0.85 PIK3CD (0.84) PIK3CDPIK3CBPIK3CAPIK3CG
SCHEMBL2675001 0.84 PIK3CD (0.74) PIK3CDPIK3CBPIK3CAPIK3CG
SCHEMBL2674471 0.83 PIK3CD (0.57) PIK3CDPIK3CBPIK3CAPIK3CG
SCHEMBL28813760 0.83 PIK3CD (0.81) PIK3CDPIK3CBPIK3CAPIK3CG
SCHEMBL2673912 0.82 PIK3CD (0.89) PIK3CDPIK3CBPIK3CAPIK3CG
SCHEMBL2674853 0.81 PIK3CD (0.88) PIK3CDPIK3CBPIK3CAPIK3CG
SCHEMBL27979137 0.81 PIK3CD (0.70) PIK3CDPIK3CBPIK3CAPIK3CG

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102459272-B Bicyclic pyrimidine PI3K inhibitor compounds selective for P110 delta, and methods of use GENENTECH INC 2014-08-06 CN disclosed